Activities per year
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The structure of the waterat the magnetite interface by nnp-based simulations
Salvatore Romano (Speaker), Pablo Montero de Hijes (Contributor) & Georg Kresse (Contributor)
23 Sept 2024 → 25 Sept 2024Activity: Talks and presentations › Poster presentation › Science to Science
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Hard antiphase domain boundaries in strontium titanate unravelled using machine-learned force fields
Andreas Tröster (Contributor), Carla Verdi (Contributor), Christoph Dellago (Contributor), Georg Kresse (Contributor) & Wilfried Schranz (Contributor)
12 Feb 2023 → 15 Feb 2023Activity: Talks and presentations › Poster presentation › Science to Science
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Hard antiphase domain boundaries in strontium titanate unravelled using machine-learned force fields
Andreas Tröster (Contributor), Carla Verdi (Contributor), Christoph Dellago (Contributor), Georg Kresse (Contributor) & Wilfried Schranz (Contributor)
26 Sept 2022 → 30 Sept 2022Activity: Talks and presentations › Poster presentation › Science to Science
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Hard antiphase domain boundaries in strontium titanate unravelled using machine-learned force fields
Andreas Tröster (Contributor), Carla Verdi (Contributor), Christoph Dellago (Contributor), Georg Kresse (Contributor) & Wilfried Schranz (Contributor)
22 Aug 2022 → 25 Aug 2022Activity: Talks and presentations › Poster presentation › Science to Science
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Hard antiphase domain boundaries in strontium titanate unravelled using machine-learned force fields
Andreas Tröster (Contributor), Carla Verdi (Contributor), Christoph Dellago (Contributor), Georg Kresse (Contributor) & Wilfried Schranz (Contributor)
3 Apr 2022 → 6 Apr 2022Activity: Talks and presentations › Poster presentation › Science to Science
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Structural analysis of hard antiphase domain wall profiles in SrTiO3 obtained from DFT+ML
Andreas Tröster (Contributor), Carla Verdi (Contributor), Christoph Dellago (Contributor), Wilfried Schranz (Contributor) & Georg Kresse (Contributor)
27 Sept 2021 → 28 Sept 2021Activity: Talks and presentations › Poster presentation › Science to Science
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Finite temperature structure of Hybrid Perovskites from ab-initio and classical MD
Jonathan Lahnsteiner (Contributor), Georg Kresse (Contributor), Jurn Heinen (Contributor) & Menno Bokdam (Contributor)
4 Apr 2019Activity: Talks and presentations › Poster presentation › Science to Science
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Calculating forces in the random phase approximation in solids
Benjamin Ramberger (Contributor) & Georg Kresse (Contributor)
17 Oct 2018Activity: Talks and presentations › Poster presentation › Science to Science
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Finite temperature structure of hybrid perovskites from ab-initio and classical MD
Jonathan Lahnsteiner (Contributor), Georg Kresse (Contributor) & Menno Bokdam (Contributor)
10 Sept 2018Activity: Talks and presentations › Poster presentation › Science to Science
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Calculating forces in the random phase approximation in solids
Benjamin Ramberger (Contributor) & Georg Kresse (Contributor)
5 Apr 2018Activity: Talks and presentations › Poster presentation › Science to Science
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Calculating forces in the random phase approximation in solids
Benjamin Ramberger (Contributor) & Georg Kresse (Contributor)
9 Jan 2018Activity: Talks and presentations › Poster presentation › Science to Science
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Assessing density functionals using many body theory for hybrid perovskites
Menno Bokdam (Contributor), Benjamin Ramberger (Contributor) & Georg Kresse (Contributor)
19 Oct 2017Activity: Talks and presentations › Poster presentation › Science to Science
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MP2 correlation energy for crystalline solids: A low complexity, high performance algorithm
Tobias Schäfer (Contributor) & Georg Kresse (Contributor)
1 Mar 2017Activity: Talks and presentations › Poster presentation › Science to Science
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Constrained random phase approximation and Cubic scaling GW
Peitao Liu (Contributor), Merzuk Kaltak (Contributor), Jiri Klimes (Contributor) & Georg Kresse (Contributor)
17 Oct 2016Activity: Talks and presentations › Poster presentation › Science to Science
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Calculating forces in the random phase approximation for solids
Benjamin Ramberger (Contributor) & Georg Kresse (Contributor)
22 Sept 2016Activity: Talks and presentations › Poster presentation › Science to Science
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Cubic scaling GW: towards fast quasiparticle calculations
Peitao Liu (Contributor), Merzuk Kaltak (Contributor), Jiri Klimes (Contributor) & Georg Kresse (Contributor)
22 Sept 2016Activity: Talks and presentations › Poster presentation › Science to Science
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MP2 exchange energy of large systems
Tobias Schäfer (Contributor) & Georg Kresse (Contributor)
11 Jan 2016Activity: Talks and presentations › Poster presentation › Science to Science
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Calculating forces in the random phase approximation for solids
Benjamin Ramberger (Contributor) & Georg Kresse (Contributor)
11 Jan 2016Activity: Talks and presentations › Poster presentation › Science to Science
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Electronic, optical and magnetic properties of Srn+1IrnO3n+1 (n=1, 2, and ?)
Peitao Liu (Contributor), Sergii Khmelevskyi (Contributor), Bongjae Kim (Contributor), Martijn Marsman (Contributor), Xing-Qiu Chen (Contributor), D. D. Sarma (Contributor), Georg Kresse (Contributor) & Cesare Franchini (Contributor)
30 Sept 2015Activity: Talks and presentations › Poster presentation › Science to Science
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Optical absorption spectra from real time propagation of orbitals
Tobias Sander (Contributor) & Georg Kresse (Contributor)
7 Sept 2015Activity: Talks and presentations › Poster presentation › Science to Science
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GW quasiparticle energies and BSE optical spectrum of perovskites: SrTiO3 and NaOsO3
Zeynep Ergönenc (Contributor), Bongjae Kim (Contributor), Peitao Liu (Contributor), Georg Kresse (Contributor) & Cesare Franchini (Contributor)
7 Sept 2015Activity: Talks and presentations › Poster presentation › Science to Science
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Periodic Table of Simple Elements
Felix Hummel (Contributor), Georg Kresse (Contributor), Jeppe C. Dyre (Contributor) & Ulf R. Pedersen (Contributor)
29 May 2015Activity: Talks and presentations › Poster presentation › Science to Science
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Effective interactions in the constrained random phase approximation
Merzuk Kaltak (Contributor), Martijn Marsman (Contributor) & Georg Kresse (Contributor)
11 Feb 2015Activity: Talks and presentations › Poster presentation › Science to Science
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Hidden Scale Invariance in Metallic Elements
Felix Hummel (Contributor), Georg Kresse (Contributor), Jeppe C. Dyre (Contributor) & Ulf R. Pedersen (Contributor)
13 Jun 2014Activity: Talks and presentations › Poster presentation › Science to Science
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Hidden Scale Invariance in Metallic Elements
Felix Hummel (Contributor), Georg Kresse (Contributor), Jeppe C. Dyre (Contributor) & Ulf R. Pedersen (Contributor)
23 Apr 2014Activity: Talks and presentations › Poster presentation › Science to Science
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Defect states and band bending effects at c-Si(111)/a-SiN:H interfaces
Leif Eric Hintzsche (Contributor), Changming Fang (Contributor), Gerald Jordan (Contributor), Martijn Marsman (Contributor), Machteld W. P. E. Lamers (Contributor), Arthur W. Weeber (Contributor) & Georg Kresse (Contributor)
2 Apr 2014Activity: Talks and presentations › Poster presentation › Science to Science
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Effective interactions in the constrained random phase approximation
Merzuk Kaltak (Contributor), Martijn Marsman (Contributor) & Georg Kresse (Contributor)
1 Apr 2014Activity: Talks and presentations › Poster presentation › Science to Science
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Electronic Properties of strained and unstrained group IV semiconductor Germanium alloys
Kerstin Hummer (Contributor), Christian Eckhardt (Contributor) & Georg Kresse (Contributor)
4 Sept 2013Activity: Talks and presentations › Poster presentation › Science to Science
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Acceleration of basis set convergence of ACFDT-RPA and MP2 correlation energies using the effective energy techniques
Jiri Klimes (Contributor), Andreas Grüneis (Contributor) & Georg Kresse (Contributor)
Aug 2013Activity: Talks and presentations › Poster presentation › Science to Science
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Efficient RPA Calculations using Green Functions on Imaginary Axes
Merzuk Kaltak (Contributor) & Georg Kresse (Contributor)
Jun 2013Activity: Talks and presentations › Poster presentation › Science to Science
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Bethe-Salpeter Equation from Many-Body Perturbation Theory
Tobias Sander (Contributor) & Georg Kresse (Contributor)
Jun 2013Activity: Talks and presentations › Poster presentation › Science to Science
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Quasiparticle Spectra from selfconsistent GW calculations
Merzuk Kaltak (Contributor) & Georg Kresse (Contributor)
May 2013Activity: Talks and presentations › Poster presentation › Science to Science
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Band structure of bismuth telluride: A challenge for theory and experiment
Kerstin Hummer (Contributor) & Georg Kresse (Contributor)
2012Activity: Talks and presentations › Poster presentation › Science to Science
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DFT and beyond-DFT derived tight-binding parameters for RMnO3 using the VASP2WANNIER90 interface
Sowmya Sathyanarayana Murthy (Contributor), Martijn Marsman (Contributor), Georg Kresse (Contributor) & Cesare Franchini (Contributor)
2012Activity: Talks and presentations › Poster presentation › Science to Science
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Defect states in amorphous silicon nitrides: a-Si3NxHy
Leif Eric Hintzsche (Contributor), Changming Fang (Contributor), Martijn Marsman (Contributor), Gerald Jordan (Contributor) & Georg Kresse (Contributor)
2012Activity: Talks and presentations › Poster presentation › Science to Science
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Quasiparticle Spectra from self-consistent GW Calculations for Transition-Metal Monoxides
Georg Kresse (Contributor) & Merzuk Kaltak (Contributor)
2012Activity: Talks and presentations › Poster presentation › Science to Science
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Bethe-Salpeter Equation in the Tamm-Dancoff Approximation and beyond
Tobias Sander (Contributor), Ronald Starke (Contributor) & Georg Kresse (Contributor)
2012Activity: Talks and presentations › Poster presentation › Science to Science
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Electronic structure calculations on 100,000 atoms
Gerald Jordan (Contributor), Martijn Marsman (Contributor) & Georg Kresse (Contributor)
2011Activity: Talks and presentations › Poster presentation › Science to Science
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Ab initio investigation of topological insulators
Kerstin Hummer (Contributor), Yoon-Suk Kim (Contributor) & Georg Kresse (Contributor)
2011Activity: Talks and presentations › Poster presentation › Science to Science
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DFT and Beyond - Climbing Jacobs Ladder
Laurids Schimka (Contributor) & Georg Kresse (Contributor)
2011Activity: Talks and presentations › Poster presentation › Science to Science
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Basis Set Independent Reformulation of Hedin's Equations - Towards a New Fundamental Set of Equations in Electronic Structure Theory
Ronald Starke (Contributor) & Georg Kresse (Contributor)
2011Activity: Talks and presentations › Poster presentation › Science to Science
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Self-consistent Green Function Equations - A Hierarchy of Approximations for the 4-Point Propagator
Ronald Starke (Contributor), Merzuk Kaltak (Contributor) & Georg Kresse (Contributor)
2011Activity: Talks and presentations › Poster presentation › Science to Science
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Ab initio free energy calculations for the desorption of oxygen from Rh(111)
Thomas Franz (Contributor) & Georg Kresse (Contributor)
2010Activity: Talks and presentations › Poster presentation › Science to Science
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2nd-order Moller-Plesset perturbation theory applied to extended systems
Martijn Marsman (Contributor), Andreas Grüneis (Contributor) & Georg Kresse (Contributor)
22 Mar 2009Activity: Talks and presentations › Poster presentation › Science to Science
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2nd-order Moller-Plesset perturbation theory applied to extended systems
Andreas Grüneis (Contributor), Martijn Marsman (Contributor) & Georg Kresse (Contributor)
8 Jan 2009Activity: Talks and presentations › Poster presentation › Science to Science
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Kinetic Monte Carlo simulations of temperture-programmed desorption
Thomas Franz (Contributor), Florian Mittendorfer (Contributor) & Georg Kresse (Contributor)
2009Activity: Talks and presentations › Poster presentation › Science to Science
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Improved description of correlation energies within the ACFDT-RPA framework
Laurids Schimka (Contributor) & Georg Kresse (Contributor)
2009Activity: Talks and presentations › Poster presentation › Science to Science
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2nd-order Moller-Plesset perturbation and coupled-cluster theory applied to extended systems
Andreas Grüneis (Contributor), Martijn Marsman (Contributor) & Georg Kresse (Contributor)
2009Activity: Talks and presentations › Poster presentation › Science to Science
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Improved description of correlation energies using the random phase approximation
Judith Harl (Contributor) & Georg Kresse (Contributor)
2009Activity: Talks and presentations › Poster presentation › Science to Science
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MP2 and RPA applied to solid state systems
Martijn Marsman (Contributor), Andreas Grüneis (Contributor), Judith Harl (Contributor) & Georg Kresse (Contributor)
2009Activity: Talks and presentations › Poster presentation › Science to Science